2166-0247 Screening compound: (E)-1-(4-chloro-3-nitrophenyl)-N-{4'-[(E)-[(4-chloro-3-nitrophenyl)methylidene]amino]-3,3'-dimethyl-[1,1'-biphenyl]-4-yl}methanimine

2166-0247 Screening compound: (E)-1-(4-chloro-3-nitrophenyl)-N-{4'-[(E)-[(4-chloro-3-nitrophenyl)methylidene]amino]-3,3'-dimethyl-[1,1'-biphenyl]-4-yl}methanimine
2166-0247 Screening compound: (E)-1-(4-chloro-3-nitrophenyl)-N-{4'-[(E)-[(4-chloro-3-nitrophenyl)methylidene]amino]-3,3'-dimethyl-[1,1'-biphenyl]-4-yl}methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2166-0247
(E)-1-(4-chloro-3-nitrophenyl)-N-{4'-[(E)-[(4-chloro-3-nitrophenyl)methylidene]amino]-3,3'-dimethyl-[1,1'-biphenyl]-4-yl}methanimine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

2166-0247

Molecular Formula

C28H20Cl2N4O4 (C28 H20 Cl2 N4 O4)

Compound Name

(E)-1-(4-chloro-3-nitrophenyl)-N-{4'-[(E)-[(4-chloro-3-nitrophenyl)methylidene]amino]-3,3'-dimethyl-[1,1'-biphenyl]-4-yl}methanimine

IUPAC name

(E)-1-(4-chloro-3-nitrophenyl)-N-{4'-[(E)-[(4-chloro-3-nitrophenyl)methylidene]amino]-33'-dimethyl-[11'-biphenyl]-4-yl}methanimine

SMILES

Cc(cc(cc1)-c(cc2)cc(C)c2/N=C/c(cc2)cc([N+]([O-])=O)c2Cl)c1/N=C/c(cc1)cc([N+]([O-])=O)c1Cl

InChI

InChI=1S/C28H20Cl2N4O4/c1-17-11-21(5-9-25(17)31-15-19-3-7-23(29)27(13-19)33(35)36)22-6-10-26(18(2)12-22)32-16-20-4-8-24(30)28(14-20)34(37)38/h3-16H,1-2H3

InChI Key

XCUZRFFIVOIHJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00594982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

547.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

8.136

Distribution Coefficient, logD

8.136

Water Solubility, LogSw

-6.82

Polar Surface Area

80.987

Acid Dissociation Constant (pKa)

28.92

Base Dissociation Constant (pKb)

3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

References: we are preparing a list of scientific research reports with 2166-0247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2166-0247?
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What is the minimum amount of 2166-0247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2166-0247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2166-0247
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 2166-0247 available by request